SCHEMBL6328556

SCHEMBL6328556

CCCCCCCC1=CC(=O)O/C1=C/Nc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
CNR1 P21554 1/20 0.39
ALDH1A1 P00352 3/20 0.38
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
HTT P42858 4/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
EPHX1 P07099 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
GAA P10253 2/20 0.35
SOAT2 O75908 1/20 0.35
SOAT1 P35610 1/20 0.35
MAPT P10636 2/20 0.35
XBP1 P17861 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
HSP90AA1 P07900 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6138886 1.00 PTPN1 (0.41) PTPN1CNR1ALDH1A1ACHEBACE1
SCHEMBL6330352 0.76 CDC25A (0.41) ALDH1A1HTTNPSR1CRHBPCRHR2
SCHEMBL6330349 0.76 CDC25A (0.41) ALDH1A1HTTNPSR1CRHBPCRHR2
SCHEMBL4651390 0.75 ACHE (0.44) PTPN1ACHEBACE1GPR84
SCHEMBL4651388 0.75 ACHE (0.44) PTPN1ACHEBACE1GPR84
SCHEMBL4651525 0.75 ACHE (0.44) PTPN1ACHEBACE1GPR84
SCHEMBL4652189 0.75 ACHE (0.44) PTPN1ACHEBACE1GPR84
SCHEMBL4652191 0.75 ACHE (0.44) PTPN1ACHEBACE1GPR84
SCHEMBL4651522 0.75 ACHE (0.44) PTPN1ACHEBACE1GPR84
SCHEMBL9697326 0.72 ACHE (0.50) PTPN1ACHEBACE1GPR84CDC25A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050215772-A1 Furanone derivatives and methods of making same BIOSIGNAL LIMITED (AT) 2005-09-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050215772-A1 Furanone derivatives and methods of making same PFAS, CFAP20, FDPS PTPN1 4196/4885CNR1 2635/4885ALDH1A1 1907/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.